SCHEMBL30051392

SCHEMBL30051392

CC(C)[C@H](N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H]1C(=O)O

nearest known ligand 0.67

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
DPP3 Q9NY33 5/20 0.67
CTSC P53634 1/20 0.55
BCHE P06276 1/20 0.54
DPP4 P27487 1/20 0.51
CYP2C19 P33261 1/20 0.51
CAPN1 P07384 2/20 0.50
CTSB P07858 2/20 0.50
ACE P12821 2/20 0.50
MMP2 P08253 2/20 0.49
MMP9 P14780 2/20 0.49
MMP8 P22894 2/20 0.49
ECE1 P42892 2/20 0.49

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL30729667 0.97 DPP3 (0.64) DPP3CTSCBCHEDPP4CYP2C19
SCHEMBL30051406 0.93 DPP3 (0.58) DPP3BCHEDPP4CYP2C19CAPN1
SCHEMBL30052939 0.93 DPP3 (0.59) DPP3BCHEDPP4CYP2C19CAPN1
SCHEMBL31198206 0.92 DPP3 (0.60) DPP3CTSCBCHEDPP4CYP2C19
SCHEMBL29420134 0.91 DPP3 (0.57) DPP3BCHEDPP4CYP2C19CAPN1
SCHEMBL30051339 0.90 DPP4 (0.58) DPP3BCHEDPP4CYP2C19
SCHEMBL30051552 0.90 DPP3 (0.56) DPP3BCHEDPP4CAPN1CTSB
SCHEMBL29380301 0.88 CAPN1 (0.58) DPP3BCHECAPN1CTSBMMP2
SCHEMBL32681277 0.88 CAPN1 (0.59) DPP3BCHECAPN1CTSBMMP2
SCHEMBL29966903 0.88 DPP4 (0.54) DPP3BCHEDPP4CYP2C19

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12622975-B2 Peptide-conjugated prodrugs BRANDEIS UNIVERSITY (US) 2026-05-12 US disclosed
US-20220387610-A1 PEPTIDE-CONJUGATED PRODRUGS NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2022-12-08 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-12622975-B2 Peptide-conjugated prodrugs PEPD, PAM, VIP DPP3 25/4885CTSC 131/4885BCHE 353/4885
US-20220387610-A1 PEPTIDE-CONJUGATED PRODRUGS VIP, DNPEP, PEPD DPP3 64/4885CTSC 37/4885BCHE 231/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.